4-[2-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione

Systemtic Name: 4-[2-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione Openeye Name: 4-[2-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-2-oxo-ethyl]-1,4-benzoxazepine-3,5-dione CAS Name: 4-[2-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-2-oxoethyl]-1,4-benzoxazepine-3,5-dione IUPAC Name: 4-[2-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-oxoethyl]-1,4-benzoxazepine-3,5-dione Traditional Name: 4-[2-keto-2-[4-(4-methylpiperidino)sulfonylphenyl]ethyl]-1,4-benzoxazepine-3,5-quinone Formula: C23H24N2O6S MolecularWeight: 456.51146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)CN3C(=O)COC4=CC=CC=C4C3=O

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)CN3C(=O)COC4=CC=CC=C4C3=O

InChI

InChI=1S/C23H24N2O6S/c1-16-10-12-24(13-11-16)32(29,30)18-8-6-17(7-9-18)20(26)14-25-22(27)15-31-21-5-3-2-4-19(21)23(25)28/h2-9,16H,10-15H2,1H3